4-[(6-iodanyl-2-thiophen-2-yl-quinazolin-4-yl)amino]-N-(1,3-thiazol-2-yl)benzenesulfonamide

Systemtic Name: 4-[(6-iodanyl-2-thiophen-2-yl-quinazolin-4-yl)amino]-N-(1,3-thiazol-2-yl)benzenesulfonamide Openeye Name: 4-[[6-iodo-2-(2-thienyl)quinazolin-4-yl]amino]-N-thiazol-2-yl-benzenesulfonamide CAS Name: 4-[(6-iodo-2-thiophen-2-yl-4-quinazolinyl)amino]-N-(2-thiazolyl)benzenesulfonamide IUPAC Name: 4-[(6-iodo-2-thiophen-2-ylquinazolin-4-yl)amino]-N-(1,3-thiazol-2-yl)benzenesulfonamide Traditional Name: 4-[[6-iodo-2-(2-thienyl)quinazolin-4-yl]amino]-N-thiazol-2-yl-benzenesulfonamide Formula: C21H14IN5O2S3 MolecularWeight: 591.46763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC3=C(C=C(C=C3)I)C(=N2)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CS5

Isomeric SMILES

C1=CSC(=C1)C2=NC3=C(C=C(C=C3)I)C(=N2)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CS5

InChI

InChI=1S/C21H14IN5O2S3/c22-13-3-8-17-16(12-13)19(26-20(25-17)18-2-1-10-30-18)24-14-4-6-15(7-5-14)32(28,29)27-21-23-9-11-31-21/h1-12H,(H,23,27)(H,24,25,26)